Vitas-M small molecule compound
propan-2-yl 4,5-dimethyl-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK432500
SMILES CC(OC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H18N2O5S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O5S/c1-9(2)24-17(21)14-10(3)11(4)25-16(14)18-15(20)12-5-7-13(8-6-12)19(22)23/h5-9H,1-4H3,(H,18,20)InChIKey
WSZCHYIPIMOYQW-UHFFFAOYSA-NSynonyms
CC(OC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc(c1C)C)C
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C
InChI=1SC17H18N2O5Sc19(2)2417(21)1410(3)11(4)2516(14)1815(20)125713(8612)19(22)23h59H14H3(H1820)
METHYLETHYL45DIMETHYL2((4NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03367229
propan2yl45dimethyl2(((4nitrophenyl)carbonyl)amino)thiophene3carboxylate
PROPAN2YL45DIMETHYL2((4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000001115021
ZINC01115021
ZINC1115021
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